Vitas-M small molecule compound
N-[(1E)-3-{(2E)-2-[3-(2,4-dinitrophenoxy)benzylidene]hydrazinyl}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]benzamide
Catalog ID
STK667888
SMILES O=C(/C(=C\c1cccs1)/NC(=O)c1ccccc1)N/N=C/c1cccc(c1)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H19N5O7S MW 557.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N5O7S/c33-26(19-7-2-1-3-8-19)29-23(16-22-10-5-13-40-22)27(34)30-28-17-18-6-4-9-21(14-18)39-25-12-11-20(31(35)36)15-24(25)32(37)38/h1-17H,(H,29,33)(H,30,34)/b23-16+,28-17+InChIKey
MTFZFOYKCHZBEG-HUMORHPISA-NSynonyms
C1=CC=C(C=C1)C(=O)NC(=CC2=CC=CS2)C(=O)NN=CC3=CC(=CC=C3)OC4=C(C=C(C=C4)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC27H19N5O7Sc3326(197213819)2923(1622105134022)27(34)3028171864921(1418)3925121120(31(35)36)1524(25)32(37)38h117H(H2933)(H3034)b2316+2817+
MFCD00822229
N((1E)3((2E)2(3(24dinitrophenoxy)benzylidene)hydrazinyl)3oxo1(thiophen2yl)prop1en2yl)benzamide
N((E)3((2E)2((3(24dinitrophenoxy)phenyl)methylidene)hydrazinyl)3oxo1thiophen2ylprop1en2yl)benzamide
O=C(C(=Cc1cccs1)NC(=O)c1ccccc1)NN=Cc1cccc(c1)Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
ZINC000003115229
ZINC102660724
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